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Name | CHEMBL209590 |
---|---|
Molecular formula | C30H25F4N5O |
IUPAC name | 5-[4-[[1-(cyclopropylmethyl)piperidin-4-ylidene]-[5-fluoro-6-(trifluoromethyl)-1H-benzimidazol-2-yl]methyl]phenyl]-6-oxo-1H-pyridine-3-carbonitrile |
Molecular weight | 547.558 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 2 |
XlogP | 5.1 |
Synonyms | BDBM50186825 5-{4-[(1-cyclopropylmethyl-piperidin-4-ylidene)-(5-fluoro-6-trifluoromethyl-1H-benzoimidazol-2-yl)-methyl]-phenyl}-6-hydroxy-nicotinonitrile |
Inchi Key | IMMIYXMQLAQCFS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H25F4N5O/c31-24-13-26-25(12-23(24)30(32,33)34)37-28(38-26)27(21-7-9-39(10-8-21)16-17-1-2-17)20-5-3-19(4-6-20)22-11-18(14-35)15-36-29(22)40/h3-6,11-13,15,17H,1-2,7-10,16H2,(H,36,40)(H,37,38) |
PubChem CID | 44413398 |
ChEMBL | CHEMBL209590 |
IUPHAR | N/A |
BindingDB | 50186825 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
136758 | Melanin-concentrating hormone receptor 1 | Q99705 | MCHR1 | Homo sapiens (Human) | 422 |
136757 | Melanin-concentrating hormone receptor 2 | Q969V1 | MCHR2 | Homo sapiens (Human) | 340 |
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